4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole

C18H16N2O — CID 4001841

IUPAC4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole
SMILESCc1[nH]nc2c1C(c1ccco1)CC(c1ccccc1)=C2
InChIInChI=1S/C18H16N2O/c1-12-18-15(17-8-5-9-21-17)10-14(11-16(18)20-19-12)13-6-3-2-4-7-13/h2-9,11,15H,10H2,1H3,(H,19,20)
InChIKeySMJQIKNMMQJRGW-UHFFFAOYSA-N
MW276.34 g/mol
LogP4.39
Rot. Bonds2

About 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole

4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole (PubChem CID 4001841) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole.

Molecular Properties

Compound Name4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole
PubChem CID4001841
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole
SMILESCc1[nH]nc2c1C(c1ccco1)CC(c1ccccc1)=C2
InChIInChI=1S/C18H16N2O/c1-12-18-15(17-8-5-9-21-17)10-14(11-16(18)20-19-12)13-6-3-2-4-7-13/h2-9,11,15H,10H2,1H3,(H,19,20)
InChIKeySMJQIKNMMQJRGW-UHFFFAOYSA-N
XLogP4.39
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Amino-4-(furan-2-yl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 3128137
6-Amino-4-[5-(2-cyanophenyl)-2-furyl]-3-methyl-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
CID 650594
3-(4-ethylphenyl)-N'-[(E)-furan-2-ylmethylidene]-1H-pyrazole-5-carbohydrazide
CID 6888582
5-tert-amyl-N-[1-(2-furyl)ethylideneamino]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 9634281
6-Amino-3-methyl-4-(5-(p-tolyl)furan-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 3737081
6-Amino-4-(5-(4-methoxyphenyl)furan-2-yl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 3829864
6-Amino-3-(3-methoxyphenyl)-4-(5-methylfuran-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 4979266
6-amino-4-[(E)-2-(2-furyl)-1-methylvinyl]-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 5291857
(E)-6-[2-[[3-[4-(furan-2-yl)phenyl]-5-methyl-1H-pyrazol-4-yl]methyl]phenoxy]-4-methylhex-4-enoic acid
CID 121269679
6-Amino-4-(5-methyl-2-furyl)-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 2908739
6-Amino-3-(4-ethoxy-phenyl)-4-furan-3-yl-1,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile
CID 2945923
6-Amino-4-(furan-2-yl)-3-{[(4-methylphenyl)sulfanyl]methyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 2961855

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole?
The IUPAC name of 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole (CID 4001841) is 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole.
What is the SMILES notation for 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole?
The canonical SMILES for 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole is Cc1[nH]nc2c1C(c1ccco1)CC(c1ccccc1)=C2.
What is the InChIKey of 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole?
The InChIKey is SMJQIKNMMQJRGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c1-12-18-15(17-8-5-9-21-17)10-14(11-16(18)20-19-12)13-6-3-2-4-7-13/h2-9,11,15H,10H2,1H3,(H,19,20).
What are the key properties of 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole?
4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole has a molecular weight of 276.34 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-3-methyl-6-phenyl-4,5-dihydro-2H-indazole is sourced from PubChem (CID 4001841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).